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1ADW

PSEUDOAZURIN

Experimental procedure
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]293
Detector technologyIMAGE PLATE
Collection date1994-03-01
DetectorMARRESEARCH
Spacegroup nameC 1 2 1
Unit cell lengths110.000, 58.400, 69.200
Unit cell angles90.00, 127.00, 90.00
Refinement procedure
Resolution20.000 - 2.500
R-factor0.189
Rwork0.189
R-free0.23900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2PAZ
RMSD bond length0.010
RMSD bond angle26.600

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Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareX-PLOR (3.1)
Refinement softwareX-PLOR (3.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.600
High resolution limit [Å]2.5002.500
Number of reflections10531
<I/σ(I)>5.83
Completeness [%]85.967.5
Redundancy42.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

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720

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3.2 M AMMONIUM SULFATE 50MM POTASSIUM PHOSPHATE PH 7.0
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirammonium sulfate3.0-3.2 (M)
21reservoirpotassium phosphate50 (mM)pH7.0

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